methyl (2S)-3-methyl-2-[2-(phenylmethoxycarbonylamino)ethanoylamino]butanoate

Systemtic Name: methyl (2S)-3-methyl-2-[2-(phenylmethoxycarbonylamino)ethanoylamino]butanoate Openeye Name: methyl (2S)-2-[[2-(benzyloxycarbonylamino)acetyl]amino]-3-methyl-butanoate CAS Name: (2S)-3-methyl-2-[[1-oxo-2-(phenylmethoxycarbonylamino)ethyl]amino]butanoic acid methyl ester IUPAC Name: methyl (2S)-3-methyl-2-[[2-(phenylmethoxycarbonylamino)acetyl]amino]butanoate Traditional Name: (2S)-2-[[2-(benzyloxycarbonylamino)acetyl]amino]-3-methyl-butyric acid methyl ester Formula: C16H22N2O5 MolecularWeight: 322.35628

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)NC(=O)CNC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CC(C)[C@@H](C(=O)OC)NC(=O)CNC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C16H22N2O5/c1-11(2)14(15(20)22-3)18-13(19)9-17-16(21)23-10-12-7-5-4-6-8-12/h4-8,11,14H,9-10H2,1-3H3,(H,17,21)(H,18,19)/t14-/m0/s1